Antibiotic G-418

AlkaPlorer ID: AK043123

Synonym: 'Geneticin', 'Antibiotic G 418', 'G 418', 'Antibiotic G-418'

IUPAC Name: (2R,3S,4S,5S)-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[(2S,3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-[(1R)-1-hydroxyethyl]oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-5-methyl-4-(methylamino)oxane-3,5-diol

Structure

SMILES: CN[C@H]1[C@H](O)[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@H]3O[C@H]([C@@H](C)O)[C@@H](O)[C@H](O)[C@H]3N)[C@@H](N)C[C@H]2N)OC[C@@]1(C)O

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InChI: InChI=1S/C20H40N4O10/c1-6(25)14-11(27)10(26)9(23)18(32-14)33-15-7(21)4-8(22)16(12(15)28)34-19-13(29)17(24-3)20(2,30)5-31-19/h6-19,24-30H,4-5,21-23H2,1-3H3/t6-,7+,8-,9-,10-,11+,12+,13+,14-,15-,16+,17+,18-,19-,20-/m1/s1

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InChIKey: BRZYSWJRSDMWLG-LFFSKFPTSA-N

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Properties Information

Molecule Weight: 496.5580000000003

TPSA: 248.39

MolLogP: -5.613

Number of H-Donors: 10

Number of H-Acceptors: 14

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information